0 mol 6 unq 0 iso 0 dist 9.94843 6.30562 5.31617 5.7654 8.31647 8.07987 numMergedOcc 0
1 mol 71 unq 0 iso 0 dist 8.39608 8.67545 5.15022 3.91691 8.92529 9.73011 numMergedOcc 0
2 mol 71 unq 1 iso 0 dist 8.39608 7.23173 11.7226 3.91691 8.92529 11.0196 numMergedOcc 0
3 mol 103 unq 0 iso 0 dist 6.36357 9.7171 5.23889 10.4989 6.79959 9.90038 numMergedOcc 0
4 mol 103 unq 1 iso 0 dist 5.52999 9.49192 7.19464 6.64985 6.79959 9.06479 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 9.96416 6.0733 13.0692 5.9683 5.79195 11.1999 numMergedOcc 0
6 mol 133 unq 1 iso 0 dist 7.17051 6.0733 8.23536 5.9683 9.2759 11.1999 numMergedOcc 0
7 mol 133 unq 2 iso 0 dist 5.9962 6.0733 5.94764 5.9683 8.76088 11.1999 numMergedOcc 0
8 mol 165 unq 0 iso 0 dist 8.68956 9.96052 7.20442 8.88567 8.7235 14.8363 numMergedOcc 0
9 mol 176 unq 0 iso 0 dist 8.49376 9.8594 8.71881 8.23203 7.98755 15.0449 numMergedOcc 0
10 mol 220 unq 0 iso 0 dist 8.55805 5.31079 8.88074 4.74145 6.39087 7.4083 numMergedOcc 0
11 mol 225 unq 0 iso 0 dist 7.47852 8.28454 6.78745 5.9027 7.65121 12.2857 numMergedOcc 0
12 mol 225 unq 1 iso 0 dist 6.22332 9.65075 6.06047 4.95393 7.65121 8.47289 numMergedOcc 0
13 mol 226 unq 0 iso 0 dist 9.5942 6.62391 7.57563 4.31761 8.52996 7.8941 numMergedOcc 0
14 mol 236 unq 0 iso 0 dist 8.20542 8.38439 7.05684 4.60599 8.63249 5.6241 numMergedOcc 0
15 mol 250 unq 0 iso 0 dist 8.65735 9.21681 15.1678 7.30402 8.69437 16.4143 numMergedOcc 0
16 mol 266 unq 0 iso 0 dist 7.51446 6.64472 7.65655 9.47559 9.39714 13.9639 numMergedOcc 0
17 mol 272 unq 0 iso 0 dist 9.52059 8.62966 9.93414 4.35986 5.37747 8.34116 numMergedOcc 0
18 mol 272 unq 1 iso 0 dist 9.52059 8.60979 13.5495 4.35986 5.37747 10.6656 numMergedOcc 0
19 mol 274 unq 0 iso 0 dist 6.28023 9.91748 5.1571 5.02003 9.34051 10.7323 numMergedOcc 0
20 mol 280 unq 0 iso 0 dist 6.0218 7.10354 6.06849 4.65268 4.45141 9.17898 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 7.47179 9.60904 9.12324 6.53276 6.45597 13.8907 numMergedOcc 0
22 mol 288 unq 0 iso 0 dist 7.47179 9.60904 9.12324 6.53276 6.45597 13.8907 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 7.47179 9.60904 9.12324 6.53276 6.45597 13.8907 numMergedOcc 0
