0 mol 26 unq 0 iso 0 dist 8.06929 4.76147 5.69955 7.56492 6.73167 8.25132 11.6455 5.30297 10.177 6.07276 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.06929 12.2574 8.6385 7.56492 6.73167 7.73394 11.6455 5.30297 7.36856 6.07276 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 8.58514 5.93227 5.69955 13.5965 6.73167 8.25132 13.421 5.30297 10.177 6.07276 numMergedOcc 0
3 mol 26 unq 3 iso 0 dist 8.58514 12.8213 8.6385 13.5965 6.73167 7.73394 13.421 5.30297 7.36856 6.07276 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 8.53164 9.40516 6.49956 8.96364 7.0561 4.3481 15.4001 13.0818 9.75237 6.87506 numMergedOcc 0
5 mol 93 unq 0 iso 0 dist 7.46327 12.3373 9.81831 8.99253 7.8435 16.1023 17.8823 15.8624 24.4789 9.19977 numMergedOcc 0
6 mol 93 unq 1 iso 0 dist 7.46327 12.3373 9.81831 8.99253 7.8435 16.1023 15.0062 14.7862 23.3751 7.28831 numMergedOcc 0
7 mol 93 unq 2 iso 0 dist 7.46327 12.3373 9.81831 8.99253 7.8435 16.1023 15.1232 9.42916 18.2573 9.71411 numMergedOcc 0
8 mol 93 unq 3 iso 0 dist 7.46327 11.6592 9.12858 8.99253 7.8435 12.4934 17.8823 15.8624 20.2792 9.19977 numMergedOcc 0
9 mol 93 unq 4 iso 0 dist 7.46327 11.6592 9.12858 8.99253 7.8435 12.4934 15.0062 14.7862 19.3357 7.28831 numMergedOcc 0
10 mol 93 unq 5 iso 0 dist 7.46327 11.6592 9.12858 8.99253 7.8435 12.4934 15.1232 9.42916 16.6164 9.71411 numMergedOcc 0
11 mol 93 unq 6 iso 0 dist 7.46327 6.09816 9.4523 8.99253 7.8435 10.8106 17.8823 15.8624 19.7304 9.19977 numMergedOcc 0
12 mol 93 unq 7 iso 0 dist 7.46327 6.09816 9.4523 8.99253 7.8435 10.8106 15.0062 14.7862 17.211 7.28831 numMergedOcc 0
13 mol 93 unq 8 iso 0 dist 7.46327 6.09816 9.4523 8.99253 7.8435 10.8106 15.1232 9.42916 17.9577 9.71411 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 8.92412 4.37081 6.69515 15.6403 6.77921 13.2918 11.5392 5.38571 11.0743 6.65731 numMergedOcc 0
15 mol 141 unq 1 iso 0 dist 8.92412 6.23566 7.86572 15.6403 6.77921 13.4066 11.5392 5.38571 9.97343 6.65731 numMergedOcc 0
16 mol 141 unq 2 iso 0 dist 6.97579 10.5394 6.69515 6.90735 6.77921 13.2918 10.9074 5.38571 11.0743 6.65731 numMergedOcc 0
17 mol 141 unq 3 iso 0 dist 6.97579 12.1215 7.86572 6.90735 6.77921 13.4066 10.9074 5.38571 9.97343 6.65731 numMergedOcc 0
18 mol 171 unq 0 iso 0 dist 8.2866 5.64994 9.11712 7.35732 8.999 4.00127 13.2349 11.6944 11.4288 7.47964 numMergedOcc 0
19 mol 195 unq 0 iso 0 dist 9.96728 7.24106 6.60567 9.71052 6.34234 5.41635 13.7654 6.0634 7.36683 6.22742 numMergedOcc 0
20 mol 195 unq 1 iso 0 dist 9.96728 7.24106 6.60567 10.1093 7.87972 11.9954 18.5024 11.4252 17.8873 9.24936 numMergedOcc 0
21 mol 195 unq 2 iso 0 dist 9.96728 12.7239 7.62942 9.71052 6.34234 6.04871 13.7654 6.0634 9.26504 6.22742 numMergedOcc 0
22 mol 195 unq 3 iso 0 dist 9.96728 12.7239 7.62942 10.1093 7.87972 8.04534 18.5024 11.4252 11.9628 9.24936 numMergedOcc 0
23 mol 212 unq 0 iso 0 dist 6.73307 6.11277 8.57827 8.99365 5.50658 6.47488 15.4968 12.8059 11.8495 9.10288 numMergedOcc 0
24 mol 212 unq 1 iso 0 dist 6.73307 6.11277 8.57827 8.99365 5.50658 6.47488 14.9778 10.7914 11.3832 6.19798 numMergedOcc 0
25 mol 212 unq 2 iso 0 dist 6.73307 6.11277 8.57827 8.99365 5.50658 6.47488 15.8449 10.2513 13.5692 7.24895 numMergedOcc 0
26 mol 212 unq 3 iso 0 dist 6.73307 6.98531 6.29767 8.99365 5.50658 3.9436 15.4968 12.8059 8.69988 9.10288 numMergedOcc 0
27 mol 212 unq 4 iso 0 dist 6.73307 6.98531 6.29767 8.99365 5.50658 3.9436 14.9778 10.7914 8.55903 6.19798 numMergedOcc 0
28 mol 212 unq 5 iso 0 dist 6.73307 6.98531 6.29767 8.99365 5.50658 3.9436 15.8449 10.2513 10.6618 7.24895 numMergedOcc 0
29 mol 252 unq 0 iso 0 dist 7.82138 7.66494 6.11473 6.96456 9.39658 5.6214 14.1491 17.2823 12.9597 8.09509 numMergedOcc 0
30 mol 252 unq 1 iso 0 dist 9.27529 7.66494 6.53679 6.96456 5.9974 5.6214 14.1491 12.0545 12.9597 8.09509 numMergedOcc 0
31 mol 252 unq 2 iso 0 dist 9.27529 12.8993 7.50201 6.96456 5.9974 7.40852 14.1491 12.0545 11.0831 8.09509 numMergedOcc 0
32 mol 266 unq 0 iso 0 dist 7.92391 4.97892 7.71657 6.11441 8.20485 4.74189 5.62193 8.62248 10.1085 9.63518 numMergedOcc 0
33 mol 279 unq 0 iso 0 dist 8.31175 9.86167 8.29305 13.1821 7.37478 8.70069 11.4634 5.89415 13.6219 8.98854 numMergedOcc 0
34 mol 279 unq 1 iso 0 dist 8.31175 9.86167 8.29305 13.1821 7.37478 8.70069 18.7559 15.1378 16.8274 9.42255 numMergedOcc 0
35 mol 279 unq 2 iso 0 dist 8.31175 9.59818 6.43341 13.1821 7.37478 4.14939 11.4634 5.89415 9.09855 8.98854 numMergedOcc 0
36 mol 279 unq 3 iso 0 dist 8.31175 9.59818 6.43341 13.1821 7.37478 4.14939 18.7559 15.1378 10.6879 9.42255 numMergedOcc 0
