0 mol 7 unq 0 iso 0 dist 6.22892 5.13744 6.36911 14.5008 13.2247 9.36807 10.5274 10.672 6.57017 7.31201 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 8.17898 12.0005 7.03948 15.8595 10.7015 6.58035 22.4927 17.3012 10.9633 8.41862 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 7.84393 6.31174 8.73972 10.1953 5.03957 8.23643 17.4635 12.6444 12.7954 8.78293 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 7.84393 6.31174 8.73972 10.1953 5.03957 8.23643 11.167 10.2708 11.0033 7.82528 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 9.10915 12.9814 8.68586 19.0957 10.6748 9.54144 17.7798 13.3487 6.23335 9.80142 numMergedOcc 0
5 mol 64 unq 1 iso 0 dist 8.66921 11.75 8.68586 16.3435 10.6748 9.54144 14.4158 13.3487 6.23335 9.80142 numMergedOcc 0
6 mol 64 unq 2 iso 0 dist 5.54343 5.68492 8.68586 12.0432 10.6748 9.54144 10.0913 13.3487 6.23335 9.80142 numMergedOcc 0
7 mol 87 unq 0 iso 0 dist 9.03114 11.1364 8.32298 9.1329 7.40574 7.51358 16.0648 14.2495 8.12939 8.93296 numMergedOcc 0
8 mol 87 unq 1 iso 0 dist 8.91602 7.62644 8.32298 5.26938 7.40574 7.51358 10.8096 14.2495 8.12939 8.93296 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 6.85677 11.7378 8.43904 14.3566 9.22558 6.19042 16.0068 14.332 6.59581 9.38288 numMergedOcc 0
10 mol 119 unq 1 iso 0 dist 6.85677 11.7378 8.43904 14.3566 9.22558 6.19042 19.0747 13.4411 8.58342 7.44174 numMergedOcc 0
11 mol 130 unq 0 iso 0 dist 9.05626 5.53247 6.89257 12.8824 7.50049 7.66168 8.63186 8.74308 6.09983 9.12581 numMergedOcc 0
12 mol 130 unq 1 iso 0 dist 9.05626 8.63186 8.74308 12.8824 7.50049 9.12581 5.53247 6.89257 6.09983 7.66168 numMergedOcc 0
13 mol 155 unq 0 iso 0 dist 6.53758 6.40439 8.87452 10.2332 4.66274 9.87281 12.0086 10.5792 10.1369 8.65888 numMergedOcc 0
14 mol 155 unq 1 iso 0 dist 6.53758 6.40439 8.87452 10.2332 4.66274 9.87281 6.76022 7.68368 6.0706 8.27111 numMergedOcc 0
15 mol 155 unq 2 iso 0 dist 6.53758 6.76022 7.68368 10.2332 4.66274 8.27111 6.40439 8.87452 6.0706 9.87281 numMergedOcc 0
16 mol 155 unq 3 iso 0 dist 6.53758 6.76022 7.68368 10.2332 4.66274 8.27111 12.0086 10.5792 5.44147 8.65888 numMergedOcc 0
17 mol 155 unq 4 iso 0 dist 7.28355 10.0058 7.16254 10.2528 5.71071 9.14392 10.5375 9.86313 7.63368 7.51198 numMergedOcc 0
18 mol 155 unq 5 iso 0 dist 7.28355 10.5375 9.86313 10.2528 5.71071 7.51198 10.0058 7.16254 7.63368 9.14392 numMergedOcc 0
19 mol 155 unq 6 iso 0 dist 8.66709 7.00069 7.39644 9.91732 10.7616 7.36102 5.49358 11.5473 5.68272 9.38946 numMergedOcc 0
20 mol 155 unq 7 iso 0 dist 8.66709 14.2312 7.70572 15.5422 7.01918 8.65888 18.2102 12.0728 10.1369 9.87281 numMergedOcc 0
21 mol 155 unq 8 iso 0 dist 8.66709 14.2312 7.70572 15.5422 7.01918 8.65888 17.8944 10.6403 5.44147 8.27111 numMergedOcc 0
22 mol 218 unq 0 iso 0 dist 9.88212 12.7227 7.17547 11.5094 7.83217 7.13323 10.9212 9.29802 4.63933 9.50586 numMergedOcc 0
23 mol 236 unq 0 iso 0 dist 6.36941 11.4732 5.34718 9.97357 7.28249 7.17676 14.1057 10.5713 7.88539 6.68463 numMergedOcc 0
24 mol 238 unq 0 iso 0 dist 8.89538 13.2905 6.77463 13.8505 5.31152 8.14172 10.4286 7.2766 10.9258 8.09066 numMergedOcc 0
25 mol 238 unq 1 iso 0 dist 8.89538 10.4286 7.2766 13.8505 5.31152 8.09066 13.2905 6.77463 10.9258 8.14172 numMergedOcc 0
26 mol 240 unq 0 iso 0 dist 7.72928 6.40204 7.03489 6.01168 4.28414 6.15305 11.4113 12.1358 11.0721 8.0951 numMergedOcc 0
27 mol 240 unq 1 iso 0 dist 9.30995 10.6805 7.03489 6.83069 4.28414 6.15305 5.79056 12.1358 11.0721 8.0951 numMergedOcc 0
28 mol 272 unq 0 iso 0 dist 4.78812 6.99865 6.73206 6.62923 5.40809 9.09992 10.3424 10.1966 9.75529 6.16449 numMergedOcc 0
