0 mol 8 unq 0 iso 0 dist 6.82379 6.56356 8.64248 5.7531 7.12263 8.83742 7.03958 5.65816 4.1204 7.27018 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 6.72502 8.09311 9.94429 11.2106 9.40479 17.9724 8.60554 6.99746 15.4445 4.90592 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 6.72502 8.09311 9.94429 11.2106 9.40479 17.9724 9.44691 7.05541 13.0295 8.16324 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 6.72502 8.09311 9.94429 5.97304 9.38831 10.8583 12.9284 10.025 15.7403 9.69752 numMergedOcc 0
4 mol 24 unq 3 iso 0 dist 6.72502 8.09311 9.94429 5.97304 9.38831 10.8583 8.60554 6.99746 15.4445 9.36461 numMergedOcc 0
5 mol 24 unq 4 iso 0 dist 6.72502 9.05357 6.88355 11.2106 9.40479 11.7085 8.60554 6.99746 11.8971 4.90592 numMergedOcc 0
6 mol 24 unq 5 iso 0 dist 6.72502 9.05357 6.88355 11.2106 9.40479 11.7085 9.44691 7.05541 4.02219 8.16324 numMergedOcc 0
7 mol 24 unq 6 iso 0 dist 6.72502 9.05357 6.88355 5.97304 9.38831 14.2818 12.9284 10.025 16.8505 9.69752 numMergedOcc 0
8 mol 24 unq 7 iso 0 dist 6.72502 9.05357 6.88355 5.97304 9.38831 14.2818 8.60554 6.99746 11.8971 9.36461 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 8.65802 9.33861 10.2518 7.23437 7.39754 11.7337 7.52354 5.8102 4.52323 8.29345 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 5.72642 7.69765 7.27912 7.21418 8.71286 14.0614 12.13 9.18958 14.889 8.85881 numMergedOcc 0
11 mol 115 unq 1 iso 0 dist 5.72642 9.42082 10.5109 7.21418 8.71286 10.3973 12.13 9.18958 10.1538 8.85881 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 7.99857 6.99446 6.29394 4.99056 8.03035 9.57341 9.11344 6.96805 5.37917 8.8562 numMergedOcc 0
13 mol 119 unq 1 iso 0 dist 7.99857 6.99446 6.29394 4.99056 8.03035 9.57341 12.7677 13.3975 15.7711 7.91683 numMergedOcc 0
14 mol 119 unq 2 iso 0 dist 8.56342 7.64052 6.29394 3.78311 8.03035 9.57341 6.52773 6.96805 5.37917 8.8562 numMergedOcc 0
15 mol 119 unq 3 iso 0 dist 8.56342 7.64052 6.29394 3.78311 8.03035 9.57341 9.23858 13.3975 15.7711 7.91683 numMergedOcc 0
16 mol 119 unq 4 iso 0 dist 6.37542 7.64052 9.64502 3.78311 7.6968 9.57341 6.52773 4.86811 5.37917 8.8562 numMergedOcc 0
17 mol 119 unq 5 iso 0 dist 6.37542 7.64052 9.64502 3.78311 7.6968 9.57341 9.23858 8.00229 15.7711 7.91683 numMergedOcc 0
18 mol 143 unq 0 iso 0 dist 8.41611 7.36975 9.05786 10.8441 5.73236 13.5717 9.14266 5.99865 13.1214 6.95372 numMergedOcc 0
19 mol 143 unq 1 iso 0 dist 8.41611 5.40637 6.16103 10.8441 5.73236 8.68663 9.14266 5.99865 4.06908 6.95372 numMergedOcc 0
20 mol 175 unq 0 iso 0 dist 5.4969 9.63417 9.37652 4.24624 7.32419 12.349 10.7017 11.2348 12.9357 8.05247 numMergedOcc 0
21 mol 175 unq 1 iso 0 dist 5.4969 9.63417 9.37652 4.24624 7.32419 12.349 9.39352 8.94702 6.43397 9.71028 numMergedOcc 0
22 mol 175 unq 2 iso 0 dist 6.4318 9.63417 4.52999 4.24624 8.31961 12.349 10.7017 9.23758 12.9357 8.05247 numMergedOcc 0
23 mol 175 unq 3 iso 0 dist 6.4318 9.63417 4.52999 4.24624 8.31961 12.349 9.39352 4.06277 6.43397 9.71028 numMergedOcc 0
24 mol 186 unq 0 iso 0 dist 6.72641 7.05695 8.1007 8.12143 7.23293 13.538 10.2534 5.91678 13.834 5.45675 numMergedOcc 0
25 mol 186 unq 1 iso 0 dist 7.20574 6.61112 8.58039 12.7155 7.55358 14.0095 19.5202 13.1254 20.4429 7.46987 numMergedOcc 0
26 mol 225 unq 0 iso 0 dist 6.6561 6.50998 6.35462 4.76151 6.53728 9.87668 13.45 14.3973 18.9885 9.23935 numMergedOcc 0
27 mol 225 unq 1 iso 0 dist 6.6561 6.50998 6.35462 4.76151 6.53728 9.87668 11.7017 13.923 17.5145 7.77552 numMergedOcc 0
28 mol 225 unq 2 iso 0 dist 6.6561 9.09424 5.94765 4.76151 6.53728 8.42121 13.45 14.3973 16.1303 9.23935 numMergedOcc 0
29 mol 225 unq 3 iso 0 dist 6.6561 9.09424 5.94765 4.76151 6.53728 8.42121 11.7017 13.923 14.5337 7.77552 numMergedOcc 0
30 mol 225 unq 4 iso 0 dist 6.6561 8.14831 11.2847 4.76151 6.53728 4.98402 13.45 14.3973 7.96454 9.23935 numMergedOcc 0
31 mol 225 unq 5 iso 0 dist 6.6561 8.14831 11.2847 4.76151 6.53728 4.98402 11.7017 13.923 4.45116 7.77552 numMergedOcc 0
32 mol 264 unq 0 iso 0 dist 7.52281 5.90924 7.36132 4.48907 5.74568 7.14086 11.0482 11.5512 13.0036 7.21655 numMergedOcc 0
33 mol 264 unq 1 iso 0 dist 6.42588 9.58916 7.36132 10.1591 5.74568 7.14086 17.025 11.5512 13.0036 7.21655 numMergedOcc 0
