0 mol 16 unq 0 iso 0 dist 9.30471 6.88552 5.05803 10.3757 7.03948 6.2983 3.83262 6.42835 5.01101 9.87867 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 9.30471 6.88552 5.05803 10.3757 7.03948 6.2983 5.7598 6.57331 4.65873 4.68733 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 8.75668 7.26966 9.67592 4.97497 8.68586 5.3948 11.5793 9.86334 5.16015 8.84224 numMergedOcc 0
3 mol 72 unq 0 iso 0 dist 8.4143 13.7926 9.78528 7.14908 9.02278 11.6894 6.53445 6.21799 7.47371 5.5067 numMergedOcc 0
4 mol 72 unq 1 iso 0 dist 8.4143 13.7926 9.78528 7.14908 9.02278 11.6894 6.27856 5.03251 9.67587 4.01021 numMergedOcc 0
5 mol 72 unq 2 iso 0 dist 8.4143 13.7926 9.78528 7.14908 9.02278 11.6894 11.2873 7.66093 7.07356 6.40102 numMergedOcc 0
6 mol 109 unq 0 iso 0 dist 9.41191 12.7291 8.69985 7.32599 5.87358 9.46098 9.45977 7.07971 4.69373 5.15674 numMergedOcc 0
7 mol 115 unq 0 iso 0 dist 7.9258 10.9791 9.33865 10.8105 7.76729 10.7942 6.27754 6.24825 6.95773 5.78043 numMergedOcc 0
8 mol 115 unq 1 iso 0 dist 7.9258 4.75197 5.83991 10.8105 7.76729 10.9739 6.27754 6.24825 6.01673 5.78043 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 9.16358 10.0911 8.94367 5.0903 8.79571 5.41704 7.07082 7.21868 8.06642 5.67107 numMergedOcc 0
10 mol 134 unq 1 iso 0 dist 9.16358 9.66197 9.86662 5.0903 8.79571 6.17103 7.07082 7.21868 4.00092 5.67107 numMergedOcc 0
11 mol 134 unq 2 iso 0 dist 6.48328 10.0911 6.37586 5.0903 5.42582 5.41704 9.80637 9.33924 6.95573 6.0991 numMergedOcc 0
12 mol 134 unq 3 iso 0 dist 6.48328 10.0911 6.37586 5.0903 5.42582 5.41704 7.07082 7.93372 8.06642 5.67107 numMergedOcc 0
13 mol 134 unq 4 iso 0 dist 6.48328 9.66197 9.71307 5.0903 5.42582 6.17103 9.80637 9.33924 10.2026 6.0991 numMergedOcc 0
14 mol 134 unq 5 iso 0 dist 6.48328 9.66197 9.71307 5.0903 5.42582 6.17103 7.07082 7.93372 4.00092 5.67107 numMergedOcc 0
15 mol 178 unq 0 iso 0 dist 9.63185 14.4816 6.69288 6.70227 8.96511 10.5783 11.4463 9.11204 8.44333 5.87125 numMergedOcc 0
16 mol 178 unq 1 iso 0 dist 9.63185 10.2893 6.43573 6.70227 8.96511 5.96647 11.4463 9.11204 6.8202 5.87125 numMergedOcc 0
17 mol 178 unq 2 iso 0 dist 9.63185 9.7684 7.17202 6.70227 8.96511 12.075 11.4463 9.11204 14.9499 5.87125 numMergedOcc 0
18 mol 178 unq 3 iso 0 dist 9.63185 5.37264 8.81551 6.70227 8.96511 9.92132 11.4463 9.11204 14.2467 5.87125 numMergedOcc 0
19 mol 204 unq 0 iso 0 dist 9.44947 10.5243 7.10633 12.7783 5.90931 5.09262 14.13 7.9133 10.7169 11.2106 numMergedOcc 0
20 mol 204 unq 1 iso 0 dist 9.44947 10.2677 8.51516 12.7783 5.90931 12.9483 14.13 7.9133 5.57347 11.2106 numMergedOcc 0
21 mol 205 unq 0 iso 0 dist 8.52924 7.17157 6.03031 15.3503 9.19704 8.66809 10.3649 6.52816 9.49403 13.4094 numMergedOcc 0
22 mol 205 unq 1 iso 0 dist 8.52924 11.993 7.26832 15.3503 9.19704 6.23291 10.3649 6.52816 13.514 13.4094 numMergedOcc 0
23 mol 205 unq 2 iso 0 dist 8.52924 9.67882 7.80463 15.3503 9.19704 13.231 10.3649 6.52816 3.56269 13.4094 numMergedOcc 0
24 mol 214 unq 0 iso 0 dist 9.92165 10.1227 9.65138 4.40728 6.97182 6.16485 14.5969 7.46481 11.4955 11.357 numMergedOcc 0
25 mol 214 unq 1 iso 0 dist 9.92165 10.1227 9.65138 5.75872 6.1175 11.5712 14.5969 7.46481 11.4955 10.9581 numMergedOcc 0
26 mol 214 unq 2 iso 0 dist 9.92165 6.83063 7.14453 4.40728 6.97182 5.33565 14.5969 7.46481 8.459 11.357 numMergedOcc 0
27 mol 214 unq 3 iso 0 dist 9.92165 6.83063 7.14453 5.75872 6.1175 5.06792 14.5969 7.46481 8.459 10.9581 numMergedOcc 0
28 mol 214 unq 4 iso 0 dist 9.92165 12.7439 8.85478 4.40728 6.97182 8.47007 14.5969 7.46481 11.1534 11.357 numMergedOcc 0
29 mol 214 unq 5 iso 0 dist 9.92165 12.7439 8.85478 5.75872 6.1175 12.8334 14.5969 7.46481 11.1534 10.9581 numMergedOcc 0
30 mol 227 unq 0 iso 0 dist 8.27093 10.9396 7.22101 6.92493 8.17891 6.43754 5.92282 5.23634 5.0317 4.09934 numMergedOcc 0
31 mol 227 unq 1 iso 0 dist 8.27093 10.9533 7.09863 6.92493 8.17891 9.13836 5.92282 5.23634 5.83175 4.09934 numMergedOcc 0
32 mol 227 unq 2 iso 0 dist 9.02226 10.9396 8.65997 9.72888 9.62609 14.6185 5.92282 6.91318 5.0317 11.5454 numMergedOcc 0
33 mol 227 unq 3 iso 0 dist 9.02226 10.9396 8.65997 6.92493 6.95902 6.43754 5.92282 6.91318 5.0317 4.09934 numMergedOcc 0
34 mol 236 unq 0 iso 0 dist 7.87233 15.6279 9.81562 4.71339 5.34718 11.8759 16.5242 9.3206 4.27181 13.0765 numMergedOcc 0
35 mol 236 unq 1 iso 0 dist 7.87233 13.7246 7.68742 4.71339 5.34718 11.3552 16.5242 9.3206 4.89609 13.0765 numMergedOcc 0
36 mol 236 unq 2 iso 0 dist 7.87233 10.5269 6.27581 4.71339 5.34718 6.04825 16.5242 9.3206 10.5774 13.0765 numMergedOcc 0
37 mol 277 unq 0 iso 0 dist 4.81916 7.94155 9.7748 6.20663 9.41725 6.58374 9.31926 9.35539 11.4555 7.07508 numMergedOcc 0
38 mol 277 unq 1 iso 0 dist 4.81916 7.94155 9.7748 6.20663 9.41725 6.58374 13.1828 8.9682 17.6038 18.3854 numMergedOcc 0
39 mol 277 unq 2 iso 0 dist 4.81916 7.94155 9.7748 6.20663 9.41725 6.58374 10.6994 6.92711 14.772 16.1088 numMergedOcc 0
