0 mol 9 unq 0 iso 0 dist 8.48677 11.4245 5.71201 13.4295 8.59513 4.09467 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 8.48677 11.4245 5.71201 13.4414 6.59312 6.00657 numMergedOcc 0
2 mol 20 unq 0 iso 0 dist 9.39589 5.5701 6.26206 9.27289 8.72342 5.45273 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 8.4051 4.33963 4.90592 6.7846 7.85986 4.21283 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 8.4051 4.33963 4.90592 8.03955 4.30252 4.97191 numMergedOcc 0
5 mol 24 unq 2 iso 0 dist 8.4051 17.4067 9.36461 6.7846 7.85986 15.6099 numMergedOcc 0
6 mol 24 unq 3 iso 0 dist 8.4051 17.4067 9.36461 8.03955 4.30252 12.5557 numMergedOcc 0
7 mol 24 unq 4 iso 0 dist 7.29868 12.0003 4.90592 13.7992 7.85986 4.21283 numMergedOcc 0
8 mol 24 unq 5 iso 0 dist 7.29868 12.0003 4.90592 8.92779 4.30252 4.97191 numMergedOcc 0
9 mol 24 unq 6 iso 0 dist 7.29868 6.00575 9.36461 13.7992 7.85986 15.6099 numMergedOcc 0
10 mol 24 unq 7 iso 0 dist 7.29868 6.00575 9.36461 8.92779 4.30252 12.5557 numMergedOcc 0
11 mol 24 unq 8 iso 0 dist 8.60554 11.2106 4.90592 13.2846 7.85986 4.21283 numMergedOcc 0
12 mol 24 unq 9 iso 0 dist 8.60554 11.2106 4.90592 12.3897 4.30252 4.97191 numMergedOcc 0
13 mol 24 unq 10 iso 0 dist 8.60554 5.97304 9.36461 13.2846 7.85986 15.6099 numMergedOcc 0
14 mol 24 unq 11 iso 0 dist 8.60554 5.97304 9.36461 12.3897 4.30252 12.5557 numMergedOcc 0
15 mol 58 unq 0 iso 0 dist 8.80614 10.4524 6.62229 4.59417 6.41008 6.21346 numMergedOcc 0
16 mol 85 unq 0 iso 0 dist 9.82915 6.37974 8.70863 11.9949 8.04853 14.1233 numMergedOcc 0
17 mol 85 unq 1 iso 0 dist 9.82915 6.37974 8.70863 13.3089 6.46549 14.3481 numMergedOcc 0
18 mol 92 unq 0 iso 0 dist 5.9465 5.69731 9.05259 12.2908 6.89071 15.041 numMergedOcc 0
19 mol 92 unq 1 iso 0 dist 6.97962 4.14907 9.05259 13.6054 6.89071 15.041 numMergedOcc 0
20 mol 92 unq 2 iso 0 dist 9.95342 11.0506 9.05259 11.2746 6.89071 15.041 numMergedOcc 0
21 mol 129 unq 0 iso 0 dist 6.28565 8.11992 9.98397 10.3933 8.98175 7.42801 numMergedOcc 0
22 mol 129 unq 1 iso 0 dist 6.28565 6.67948 9.94578 10.3933 8.98175 11.1054 numMergedOcc 0
23 mol 135 unq 0 iso 0 dist 5.62052 5.66293 9.40325 3.78012 8.72359 6.40035 numMergedOcc 0
24 mol 135 unq 1 iso 0 dist 5.62052 5.66293 9.40325 10.9403 7.02963 15.0661 numMergedOcc 0
25 mol 135 unq 2 iso 0 dist 5.62052 7.79226 8.25527 3.78012 8.72359 9.24509 numMergedOcc 0
26 mol 135 unq 3 iso 0 dist 5.62052 7.79226 8.25527 10.9403 7.02963 8.72293 numMergedOcc 0
27 mol 135 unq 4 iso 0 dist 5.62052 13.2293 8.83856 3.78012 8.72359 15.5423 numMergedOcc 0
28 mol 135 unq 5 iso 0 dist 5.62052 13.2293 8.83856 10.9403 7.02963 6.66299 numMergedOcc 0
29 mol 135 unq 6 iso 0 dist 7.85645 10.1275 9.40325 9.62654 8.72359 6.40035 numMergedOcc 0
30 mol 135 unq 7 iso 0 dist 7.85645 10.1275 9.40325 8.06169 7.02963 15.0661 numMergedOcc 0
31 mol 135 unq 8 iso 0 dist 7.85645 6.99298 8.25527 9.62654 8.72359 9.24509 numMergedOcc 0
32 mol 135 unq 9 iso 0 dist 7.85645 6.99298 8.25527 8.06169 7.02963 8.72293 numMergedOcc 0
33 mol 135 unq 10 iso 0 dist 7.85645 12.8689 8.83856 9.62654 8.72359 15.5423 numMergedOcc 0
34 mol 135 unq 11 iso 0 dist 7.85645 12.8689 8.83856 8.06169 7.02963 6.66299 numMergedOcc 0
35 mol 141 unq 0 iso 0 dist 8.10291 11.2667 9.78667 8.76709 4.92382 11.2139 numMergedOcc 0
36 mol 141 unq 1 iso 0 dist 8.10291 7.52924 8.47026 8.76709 4.92382 10.7006 numMergedOcc 0
37 mol 141 unq 2 iso 0 dist 9.97343 13.8236 7.64956 6.45283 9.38036 11.2655 numMergedOcc 0
38 mol 141 unq 3 iso 0 dist 9.70413 6.30121 7.64956 11.3136 9.38036 11.2655 numMergedOcc 0
39 mol 151 unq 0 iso 0 dist 5.93692 6.16846 4.74531 6.93455 8.1948 10.247 numMergedOcc 0
40 mol 194 unq 0 iso 0 dist 8.65535 6.66155 6.37788 12.8006 8.43182 8.68259 numMergedOcc 0
41 mol 194 unq 1 iso 0 dist 8.65535 5.4499 8.7028 12.8006 8.43182 9.38176 numMergedOcc 0
42 mol 222 unq 0 iso 0 dist 9.07471 6.42798 9.08955 6.70898 9.30639 3.98816 numMergedOcc 0
43 mol 232 unq 0 iso 0 dist 8.50102 5.8023 6.57921 6.95968 9.78273 6.20756 numMergedOcc 0
44 mol 232 unq 1 iso 0 dist 9.40808 8.25884 6.57921 4.04428 9.78273 6.20756 numMergedOcc 0
45 mol 237 unq 0 iso 0 dist 9.20822 5.65087 5.06628 7.00249 8.95332 5.20161 numMergedOcc 0
46 mol 274 unq 0 iso 0 dist 8.52587 5.90436 8.2997 12.5154 8.09181 13.6012 numMergedOcc 0
47 mol 274 unq 1 iso 0 dist 6.39866 10.4342 8.2997 4.60007 8.09181 13.6012 numMergedOcc 0
48 mol 278 unq 0 iso 0 dist 8.00673 6.54009 7.21972 13.7796 8.1769 8.48896 numMergedOcc 0
49 mol 278 unq 1 iso 0 dist 8.00673 6.54009 7.21972 10.2359 7.1656 4.35961 numMergedOcc 0
50 mol 278 unq 2 iso 0 dist 6.62841 5.73336 7.21972 9.26354 8.1769 8.48896 numMergedOcc 0
51 mol 278 unq 3 iso 0 dist 6.62841 5.73336 7.21972 5.33325 7.1656 4.35961 numMergedOcc 0
