Compound Id	TPSA
26325084	83.070
26325083	73.840
18019	36.92
8521	36.92
26325082	64.610
10449	55.380
61149	0.0
2056044	0.0
26325081	55.380
26824	27.69
8520	27.69
10451	46.150
2041618	27.69
6191	0.0
26325080	46.150
76894	27.69
16425	0.0
6153	0.0
10784857	55.380
38403	9.23
14021447	36.92
9256	0.0
23101	18.46
10675065	0.0
10652594	46.150
10696	36.92
62827	0.0
11434292	18.46
21106179	0.0
122090	18.46
11557190	27.69
9095782	0.0
12577	0.0
9286	0.0
61346	0.0
6190	0.0
6270	36.92
9484	0.0
6105	0.0
16841	0.0
4927801	46.150
109705	0.0
9088156	44.480
56144	0.0
23150	9.23
108106	36.92
78828	18.46
6128	0.0
10452	27.69
10606755	20.23
3631	9.23
69569	18.46
15413	27.69
66656	9.23
9411	26.3
454209	0.0
10733068	46.150
17619	9.23
13837650	0.0
13853215	0.0
9392	0.0
66567	20.23
18971812	0.0
66655	9.23
68328	9.23
13299573	0.0
56117	18.46
12161	36.92
107412	0.0
67414	27.69
13803	27.69
14441700	0.0
10756390	36.92
68224	36.92
61213	0.0
9254	0.0
9016	0.0
73583	0.0
14998	9.23
2018165	0.0
6148	0.0
69914	27.69
11671339	27.69
29040	0.0
67991	9.23
454215	0.0
62826	0.0
7626	9.23
59573	18.46
6156	0.0
10106	54.570
10801109	32.050
512621	3.24
12933	53.710
11996	9.23
13835836	18.46
9633	0.0
15789876	85.35
18688	26.3
12586	26.880
71433	0.0
68503	27.69
937	0.0
692	17.07
23208	40.130
291	0.0
274	34.14
6084	0.0
6132	0.0
7956	9.23
6094	0.0
11749	9.23
7555	0.0
6120	0.0
7712	0.0
6308	0.0
9646	0.0
10781	0.0
15802	0.0
17976	0.0
7767	0.0
7604	0.0
7010	0.0
6163	0.0
6340	0.0
7671	26.3
9377	0.0
8560	0.0
11094	0.0
11023	0.0
11055	0.0
10786	0.0
7619	0.0
10755	0.0
11551	0.0
349	0.0
11035	0.0
11104	0.0
10795	0.0
10445	0.0
8569	9.23
11841	9.23
7073	26.3
123860	18.46
7849	0.0
17558	0.0
13439	0.0
13402	0.0
6287	54.570
10227261	68.28
14840	0.0
13448	0.0
12220	9.23
13619	0.0
7890	0.0
11882	0.0
11883	0.0
10540	0.0
7929	0.0
11897	0.0
11899	0.0
12017	0.0
12072	0.0
11900	0.0
11901	0.0
11146	0.0
11902	0.0
10542	0.0
11906	0.0
7823	9.23
13835376	18.46
55130	26.3
6188	0.0
127750	18.46
14299946	57.150
30713	0.0
14694	0.0
99596	0.0
11849	9.23
7757	26.3
21106169	20.23
20545	37.3
10441	9.23
14672	9.23
7511	26.3
10446	26.3
7657	26.3
22453	26.3
6151	0.0
7509	26.3
7872	26.3
10433	26.3
55084	26.3
7875	26.3
2062437	0.0
7065	26.3
11992	26.3
7913	26.3
10325078	0.0
92731	0.0
14256731	51.21
3168	9.23
11153	0.0
29005	26.3
7472	26.3
11207996	40.130
7694	26.3
11833	9.23
16388	53.990
455420	9.23
62249	26.3
10420	26.3
9243	0.0
55188	9.23
7482	26.3
11716	26.3
29016	26.3
7670	17.07
7340	3.24
7747	26.3
7624	12.03
7627	26.3
8568	26.3
14846	26.3
11045	26.3
11228	9.23
10709	9.23
109838	18.46
7478	35.53
10765	0.0
13849665	78.9
7800	26.3
11148	0.0
11843	26.3
923	51.210
7475	26.3
12201	0.0
7515	26.3
29012	26.3
10797	17.07
11109	0.0
7538	26.3
7536	26.3
12972	17.07
61266	0.0
24142	0.0
14829	0.0
23055	0.0
13622	0.0
7463	26.3
10571	26.3
16180	0.0
13836549	0.0
7891	0.0
12446	0.0
55123	26.3
10614293	0.0
29025	0.0
11755	26.3
12635	0.0
7706	26.3
7761	26.3
11121	0.0
7713	0.0
12809	0.0
11230	3.24
7833	0.0
10492	26.3
13837190	18.46
13839109	35.53
7556	0.0
12012	26.3
8158	3.24
66675	0.0
7871	17.07
3441	0.0
7954	0.0
9976	17.07
21153	17.07
14688	23.06
9391	20.23
8525	26.3
7514	17.07
11680	26.3
6176	17.07
6085	0.0
63631	3.24
13865630	52.6
7856	12.03
11706	26.3
7802	17.07
12218	17.07
56232	23.06
3973	9.23
6130	0.0
7534	17.07
10788	17.07
7621	17.07
10101	54.570
28986	17.07
13839575	27.69
12632	17.07
13836589	18.46
83734	0.0
9253	0.0
215929	17.07
10791	17.07
555074	0.0
7957	0.0
11125	26.3
7760	17.07
4516601	0.0
8562	12.03
2863	37.3
56442	0.0
4483639	0.0
11919	0.0
10653	26.3
8329688	0.0
7782	26.3
4516599	0.0
16387	49.45
10777	17.07
4512361	0.0
11095	17.07
11025	17.07
26325086	27.69
21106173	27.69
13835706	78.9
441	17.07
2282428	0.0
9251	0.0
13850879	99.13
217	0.0
1114	3.24
7838	17.07
15486	20.23
56559	20.23
11898	20.23
4483638	0.0
6335	26.3
4449912	0.0
11526	35.53
6311	23.79
10054	0.0
7081	17.07
7607	17.07
7074	26.3
12456	0.0
72522	20.23
6313	17.07
7817	9.23
4512642	0.0
7928	20.23
7734	26.3
5949	17.07
62632	23.79
14348	20.23
7803	37.3
7076	26.3
78998	23.79
17880	0.0
370	37.3
29029	17.07
11884	23.79
2581	20.23
16177	23.79
7730	12.03
13866746	0.0
7016	17.07
15853	23.79
11864	0.0
9053802	20.23
21106586	43.370
67360	23.79
63863	49.69
11891	20.23
7732	9.23
18920	20.23
10113	0.0
11866	23.79
15846	23.79
11845	0.0
15954	20.23
11819	20.23
7566	23.79
29026	23.79
7772	17.07
11739	20.23
7917	20.23
6321	17.07
12209	0.0
11846	23.79
7622	20.23
11861	20.23
15016	26.02
11056	20.23
7915	20.23
23255	26.02
10787	20.23
123993	20.23
55090	0.0
11806	0.0
7630	43.370
8552	37.3
68179	29.43
7901	20.23
6121	0.0
7770	23.79
7558	0.0
11036	20.23
10001	37.3
7064	37.3
175	17.07
6146	20.23
6649	37.3
11029	20.23
6123	26.02
7892	20.23
8576	26.02
6095	0.0
9461	9.23
14692	0.0
11099	0.0
11193	37.3
256	17.07
11794	20.23
7851	26.02
15387	26.02
8012	37.3
7717	23.79
11732	20.23
10511	20.23
654	12.03
6315	0.0
6086	0.0
99440	20.23
11194	20.23
455353	29.46
11110	0.0
13848341	52.6
10265264	0.0
7850	0.0
7882	20.23
7577	26.3
29000	20.23
8574	20.23
11239	20.23
6165	20.23
11865	0.0
21011	20.23
4366810	38.33
512	17.07
11793	20.23
7811	26.02
7835	26.02
11216	20.23
13862665	26.3
932	20.23
22814	0.0
6341	37.3
11678	20.23
11543	20.23
62230	20.23
7533	20.23
13836399	29.46
10526	0.0
10422	38.33
12069	43.14
59483	36.090
13255	9.23
10179173	0.0
7701	37.3
6149	0.0
10790	20.23
71430	27.69
120464	0.0
172	17.07
11180	20.23
13865426	43.370
7434	20.23
259	37.3
7714	0.0
10512	0.0
7812	20.23
7769	26.02
7459	20.23
11024	20.23
7837	20.23
3644	20.23
16778	29.46
7705	29.46
191367	43.14
748	23.79
5091	37.3
10437	0.0
387	43.14
6312	20.23
6320	20.23
10947	20.23
6040	20.23
8398	20.23
960	37.3
6164	20.23
18410	0.0
7546	12.53
11756	52.370
7616	26.3
258	20.23
7716	26.02
7564	26.02
7024	0.0
7090	0.0
15438	0.0
11699	38.33
16791	0.0
6097	0.0
11799	43.14
6187	0.0
21800	0.0
18717	20.23
13837797	9.23
16641	29.43
10205670	37.3
12442	0.0
6186	0.0
60329	35.25
7790	27.69
1005	37.3
11210	20.23
6101	26.02
1004	20.23
2340753	0.0
10325184	0.0
24590970	0.0
11695	38.33
6102	23.79
13836591	29.46
7028	9.23
7615	43.14
13884973	40.46
7674	0.0
6406	26.3
682	20.23
13874867	43.370
10710415	35.53
6089	26.02
6087	0.0
6098	0.0
7733	9.23
9990	0.0
11727	29.43
7600	37.3
8896	0.0
7466	38.33
14751	0.0
1609	35.25
171	37.3
7727	35.25
71628	27.03
22408	0.0
7728	29.46
6338	43.14
13811	23.550
13871489	93.060
864	20.23
220998	32.67
221117	0.0
15765	0.0
11647	26.3
7506	17.07
7737	9.23
5439	52.32
7003	26.3
6322	17.07
13867413	50.09
553171	52.6
11525	20.23
8554	9.23
13571291	23.79
12066	18.46
7703	29.260
11265	32.67
12954	32.67
13229	32.67
59577	20.310
10053	0.0
10018	18.46
7787	0.0
26765	29.1
192642	29.1
11788	3.24
63156	20.23
122446	29.1
21181	29.1
26325090	41.46
13836520	21.760
6135	43.14
6309	0.0
12626	20.23
11632	32.67
9994	9.23
7636	35.53
13854944	23.47
7557	0.0
6125	0.0
120621	29.1
4449	52.04
55205	29.1
12445	29.1
14169248	41.46
7964	85.040
6193	85.040
62597	20.23
7559	17.07
7677	26.02
12197	0.0
13836674	0.0
11761	25.3
29015	18.46
9642	0.0
156255	52.04
20119	29.1
6118	0.0
363458	21.260
7684	12.47
71390	0.0
8544	0.0
12219	0.0
6307	0.0
7848	0.0
13816	29.1
15077490	0.0
19956441	41.46
12637	58.86
13872989	20.23
11752	29.1
8577	38.8
278	37.3
61487	0.0
11863	0.0
5708	32.67
10536	25.3
14349	38.8
7810	0.0
391	0.0
13835977	26.02
6334	29.1
592	57.53
13871721	20.23
374462	52.04
558883	0.0
56020	0.0
8908	0.0
376	74.6
10025	74.6
5004	74.6
2275	26.3
4446445	17.07
10124	0.0
7852	38.8
3951	37.3
7530	6.48
7766	0.0
6333	37.3
14680	38.8
7827	25.3
4514529	0.0
13835316	0.0
7711	0.0
12499	20.23
19953955	41.46
21109330	40.46
13638	12.03
72056	40.46
10948	40.46
7815	38.8
71312	0.0
2293678	0.0
2018460	0.0
29107	20.310
21169510	26.3
7552	0.0
5993	20.310
13835293	40.46
62589	12.03
7738	13.14
7686	12.03
7480	29.1
7776	38.8
127983	17.07
1087	34.14
6092	0.0
6042	0.0
6316	0.0
8878	0.0
34095	40.46
7568	23.79
10340	13.14
4444608	17.07
10939	17.07
11107	55.120
13835224	40.46
8141	17.07
9233	25.3
23621376	41.46
21111806	0.0
69371	25.3
66565	12.89
18685	40.46
15443	17.07
844	74.6
18607	25.3
11930	23.550
62628	40.46
67653	0.0
7030	35.53
11875	40.46
7721	38.8
2656	9.23
21108550	0.0
7560	38.8
13839416	40.46
13836021	32.26
13835861	46.25
7029	26.3
394562	17.07
10498	23.79
13839441	40.46
21112738	0.0
6104	0.0
4481813	32.59
60524	32.59
11729	25.3
9325	0.0
11694	41.13
11086	0.0
13849981	20.23
6103	38.8
5894	32.67
13835209	40.46
7788	0.0
13839553	40.46
6083	0.0
6314	17.07
61707	43.09
63054	20.23
4510484	17.07
15803	20.23
26563	55.380
70660	75.63
7679	17.07
13835235	40.46
1039	25.3
10772140	37.3
28994	29.1
4937830	20.23
29008	12.03
11809	20.23
8543	0.0
6111	0.0
68832	34.14
13842001	23.47
22191	34.14
75951	34.14
72793	34.14
72551	34.14
24641	34.14
11632871	46.150
33416	46.150
29001	34.14
21106032	0.0
8909	0.0
11857	0.0
7330	0.0
69982	86.28
21106015	20.23
552744	37.3
10464	43.09
61191	20.23
61001	17.07
8912	36.92
7791	12.03
13866593	52.04
7098	20.23
7026	20.23
553742	0.0
5977	0.0
13837702	52.04
13837537	21.260
9724	0.0
18801	46.25
59674	20.23
558928	0.0
6330	43.09
11244	46.330
7021	41.13
11795	43.09
10488	26.3
13647	43.14
6402	0.0
68156	46.25
71876	26.3
415	52.04
10487	0.0
763	40.46
13835336	46.25
24099	46.25
173	43.09
5730	0.0
7678	20.23
553642	0.0
13861343	43.14
13835550	52.04
8733	46.25
48024	15.27
10265270	0.0
693	43.09
124968	25.78
62808	25.78
8910	0.0
9614	0.0
60886	0.0
28993	0.0
17131	27.69
13875283	0.0
9363	12.89
13849989	20.23
11351244	0.0
558020	25.78
7553	0.0
20939	0.0
518	0.0
6326	0.0
20198	74.6
1143	69.11
61111	12.89
4444456	0.0
2441	17.07
6296	17.07
391428	0.0
733	60.69
9970	20.23
8960	52.04
11117	0.0
191	74.6
13837280	0.0
659	36.28
1078	74.6
13835604	52.490
10772050	37.3
14198	0.0
71787	72.19
7528	24.06
6827	0.0
499714	43.09
7018	40.46
11911	0.0
6093	0.0
13836713	38.8
21106535	20.23
7013	0.0
59447	24.06
10179239	0.0
86007	86.740
390927	20.23
10756	20.23
7961	20.23
12643	20.23
19231	29.540
13835630	63.930
13835459	24.06
9581	9.23
13875196	9.23
73412	0.0
13492	0.0
15747	0.0
7236	32.59
10410	0.0
1348	17.82
558878	17.07
5978	42.52
13487	0.0
6119	0.0
10404	0.0
13839199	12.89
9228	0.0
71089	25.78
6342	0.0
9574	37.3
83866	40.46
83850	40.46
9454	37.3
7419	0.0
1108	0.0
7128	0.0
8356	0.0
62530	12.89
7385	0.0
7170	0.0
8903	25.78
13842613	12.89
16159	0.0
7183	0.0
236	0.0
553578	17.07
7736	15.79
7242	12.89
7219	0.0
7521	0.0
7672	0.0
12010	0.0
24533	25.78
789	74.6
7088	0.0
1019	0.0
13835932	80.92
65750	12.89
15461	0.0
11830	0.0
6122	0.0
1095	25.3
7641	0.0
63903	12.89
10497	0.0
8904	25.78
7688	25.78
13874733	12.89
10437135	35.010
11660	0.0
1020	12.89
21106520	12.89
18724	12.89
11042	12.89
31029	0.0
21106560	12.89
21132380	12.89
8531	0.0
15855	17.07
6100	0.0
13837281	0.0
21105905	12.89
66809	22.12
7448	0.0
6179	0.0
7659	0.0
24535	25.78
15702	32.34
25552	25.78
11871	50.6
15409	26.3
20843	25.78
10940	12.89
10251740	50.44
11077	12.89
24972	25.78
9326	20.23
13885245	26.3
6524	52.6
28969	26.3
6967	0.0
8900	0.0
12229	26.940
9360	20.23
10253	0.0
8902	25.78
9350	20.23
7786	50.6
6999	0.0
15965	26.3
6088	0.0
10937	12.89
21106036	43.14
6977	0.0
10364	0.0
62489	22.12
10384035	35.010
11409	0.0
8243	52.6
7391	9.23
21108577	35.53
13257	26.940
70682	0.0
4228778	55.380
13658	25.78
28992	25.78
6528	52.6
7739	28.24
21168808	28.24
8335	0.0
8374	26.3
21111820	28.24
6897	26.3
13863629	30.21
12228	0.0
21112023	17.07
6665	63.370
247721	26.3
10437215	35.010
11731	50.6
13865438	9.23
120489	35.010
2039535	35.010
13837319	52.6
7278	26.3
13875160	0.0
8899	41.130
7238	9.23
21106135	9.23
773	28.68
2916	0.0
12225	0.0
10197150	74.6
55091	43.09
26325085	40.46
26325087	40.46
26325088	40.46
11862	0.0
8241	52.6
3210	20.23
8950	0.0
7676	0.0
66996	25.78
10437074	25.78
66896	17.07
30595	26.3
7710	0.0
7809	0.0
63908	36.17
221226	36.17
21105959	9.23
66021	25.78
17443	35.010
84971	101.15
388391	101.15
10236	0.0
13837303	52.6
13648	29.96
2849146	52.08
222538	52.08
73390	52.08
10437335	52.08
11576	37.3
11589	37.3
7175	26.3
79969	37.3
11784	12.89
7765	0.0
6883	26.3
7241	36.68
13875230	0.0
7689	12.89
2038738	49.57
11785	12.89
9218	29.1
7224	23.79
11600	30.21
7551	0.0
558875	0.0
21106366	17.07
78	36.68
7225	36.68
10181339	37.3
13839308	23.79
65523	52.08
7157	26.3
2937774	53.240
502855	52.6
14556	39.19
30572	100.620
58234	20.23
67460	23.79
9349	26.02
8883	0.0
65936	49.57
13875281	0.0
4445317	17.07
10534	0.0
6898	34.14
13644	29.96
12061	23.79
29036	0.0
199342	17.07
66895	17.07
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62408	29.43
13837329	52.6
4489	34.14
15495	46.53
66887	17.07
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9893	17.07
63518	17.07
12060	20.23
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7420	0.0
13856009	29.96
59482	17.07
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14678	20.23
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7984	80.92
28982	20.23
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21105897	46.53
13860335	20.23
6881	17.07
55443	20.23
453675	20.23
971	20.23
9579	37.3
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60121	29.46
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63310	40.620
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305	132.13
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21106091	20.23
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5830	20.23
69340	20.23
63889	26.940
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7132	17.07
235	17.07
13839082	20.23
13839110	20.23
13840690	0.0
13871718	20.23
21105871	20.23
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24722	55.380
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9903	0.0
13839105	20.23
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440	121.380
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447	29.46
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13835772	20.23
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8071	37.3
13839128	20.23
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5979	0.0
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7220	0.0
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9911	20.23
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67465	29.1
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13837686	20.23
13839174	20.23
61538	20.23
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61411	20.23
69177	20.23
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21106144	43.14
21106524	17.07
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12674	0.0
13837988	0.0
6775	47.58
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70715	25.78
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13875392	0.0
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12231	20.310
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13835151	26.02
13875320	0.0
14227	17.07
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7310	38.33
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13860692	26.02
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9564	40.46
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6794	3.24
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13835126	17.07
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924	3.24
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65	20.23
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13860641	26.02
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13837760	40.46
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13837787	66.05
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21108548	0.0
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392	46.25
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21106571	0.0
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21106540	0.0
132	57.53
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13875212	0.0
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10437210	75.680
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992	74.6
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10628694	50.94
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56769	0.0
56780	0.0
34847	0.0
39406	0.0
35081	0.0
56781	0.0
56771	0.0
4575338	52.930
970	0.0
56774	0.0
82765	0.0
34854	0.0
46136	0.0
82736	0.0
56759	0.0
36984	0.0
5026	106.35
2457	46.33
96965	0.0
33198	0.0
3513	135.12
34853	0.0
37745	0.0
36978	0.0
34190	0.0
34191	0.0
36771	0.0
36710	0.0
56757	0.0
549017	0.0
84347	0.0
56764	0.0
56758	0.0
47914	0.0
56762	0.0
33984	0.0
33983	0.0
11283	13.59
2625	31.78
26325089	31.78
13328	12.53
16736498	54.740
23977588	54.740
3584	68.53
5198	52.9
6593	15.79
82783	0.0
34852	0.0
37000	0.0
37019	0.0
56765	0.0
39198	0.0
82740	0.0
56761	0.0
56756	0.0
56766	0.0
83413	0.0
34851	0.0
36976	0.0
56767	0.0
56763	0.0
35108	0.0
10162	92.680
6842	50.6
15827	0.0
5552	94.83
34859	0.0
84346	0.0
56760	0.0
56755	0.0
33666	0.0
106796	94.570
9187483	0.0
3322	131.010
5768	189.530
54833	57.61
11439687	88.94
4444479	93.060
33986	0.0
36983	0.0
36986	0.0
45447	0.0
35566	0.0
47916	0.0
46137	0.0
550258	0.0
33985	0.0
26286843	83.68
11917	0.0
3841535	83.68
65234	96.220
55075	40.46
34860	0.0
82738	0.0
36982	0.0
36979	0.0
47915	0.0
56783	0.0
36981	0.0
37004	0.0
36980	0.0
56782	0.0
36977	0.0
83414	0.0
84348	0.0
82823	0.0
4624	97.990
26325183	77.36
4444100	86.990
34192	0.0
82822	0.0
6013	138.03
70806	17.07
15520	35.58
8860	12.89
4444107	107.98
36990	0.0
35912	0.0
45448	0.0
36987	0.0
36988	0.0
33407	0.0
36985	0.0
35205	0.0
15637	0.0
82821	0.0
21106058	49.410
31006	158.260
35206	0.0
82751	0.0
36989	0.0
11369	20.23
15484	0.0
5113	32.78
5739	0.0
8816	0.0
8817	0.0
4444102	107.220
4471584	136.220
4444553	136.22
8800	0.0
29153	0.0
8804	0.0
8799	0.0
8788	0.0
4067	163.180
21105591	49.410
6045	182.83
75662	189.0
9219586	37.3
1043	155.050
2246	0.0
29400	206.07
21105594	62.550
5678	0.0
8763	0.0
21106077	49.410
4444362	265.52